3-(1,3-benzodioxol-5-yl)-N-[(4-ethylphenyl)-thiophen-2-yl-methyl]propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[(4-ethylphenyl)-thiophen-2-yl-methyl]propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[(4-ethylphenyl)-(2-thienyl)methyl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[(4-ethylphenyl)-thiophen-2-ylmethyl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[(4-ethylphenyl)-thiophen-2-ylmethyl]propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[(4-ethylphenyl)-(2-thienyl)methyl]propionamide Formula: C23H23NO3S MolecularWeight: 393.49862

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H23NO3S/c1-2-16-5-9-18(10-6-16)23(21-4-3-13-28-21)24-22(25)12-8-17-7-11-19-20(14-17)27-15-26-19/h3-7,9-11,13-14,23H,2,8,12,15H2,1H3,(H,24,25)